| Literature DB >> 20726595 |
Abstract
A signature for any reaction is defined by just the net change in bonding of the reacting atoms in the conversion of reactant to product structures. This reaction signature is both unique and definitive for any reaction and consists of a simple linear string of letters suitable to index every reaction in a reaction database for computer access. This allows daily entry of new reactions to be easily incorporated and later retrieved with all related reactions from the reaction database.Mesh:
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Year: 2010 PMID: 20726595 DOI: 10.1021/ci1000482
Source DB: PubMed Journal: J Chem Inf Model ISSN: 1549-9596 Impact factor: 4.956